Selected Descriptors from the BlueStar STING database that were used for IFR prediction.

Labels: Cα = Carbon alpha; LHA = Last heavy atom; MM = Main chain – Main chain; MS = Main chain – Side chain; SS = Side chain – Side chain; W = Water molecule; WW = 2x Water molecules.*A complete description of the listed physicochemical and structural attributes is given at http://www.cbi.cnptia.embrapa.br/SMS and in [10]–[13], [20].

标签说明：Cα（Carbon alpha，α碳）；LHA（Last heavy atom，最后一个重原子）；MM（Main chain – Main chain，主链-主链）；MS（Main chain – Side chain，主链-侧链）；SS（Side chain – Side chain，侧链-侧链）；W（Water molecule，水分子）；WW（2x Water molecules，双水分子，即两个水分子）。上述所列的理化性质与结构属性的完整说明已刊载于http://www.cbi.cnptia.embrapa.br/SMS 以及文献[10]–[13]、[20]中。